| SpectraBase Compound ID | FoGe6DOS6O2 |
|---|---|
| InChI | InChI=1S/C15H22BrNO/c1-4-6-11-17(12(3)5-2)15(18)13-9-7-8-10-14(13)16/h7-10,12H,4-6,11H2,1-3H3 |
| InChIKey | QQDYEZLNWKOCRK-UHFFFAOYSA-N |
| Mol Weight | 312.25 g/mol |
| Molecular Formula | C15H22BrNO |
| Exact Mass | 311.088477 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JM73y7Uap6r |
|---|---|
| Name | Benzamide, 2-bromo-N-(2-butyl)-N-butyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 311.088477331 u |
| Formula | C15H22BrNO |
| InChI | InChI=1S/C15H22BrNO/c1-4-6-11-17(12(3)5-2)15(18)13-9-7-8-10-14(13)16/h7-10,12H,4-6,11H2,1-3H3 |
| InChIKey | QQDYEZLNWKOCRK-UHFFFAOYSA-N |
| Molecular Weight | 312.251 g/mol |
| SMILES | C(=O)(N(CCCC)C(CC)C)C=1C(Br)=CC=CC1 |